6-[(6-chloranylpyridin-3-yl)methyl]-3-methyl-1-[(1-methylpyrrolidin-2-yl)methyl]-5-phenylazanyl-pyrrolo[3,4-d]pyrimidine-2,4-dione

Systemtic Name: 6-[(6-chloranylpyridin-3-yl)methyl]-3-methyl-1-[(1-methylpyrrolidin-2-yl)methyl]-5-phenylazanyl-pyrrolo[3,4-d]pyrimidine-2,4-dione Openeye Name: 5-anilino-6-[(6-chloro-3-pyridyl)methyl]-3-methyl-1-[(1-methylpyrrolidin-2-yl)methyl]pyrrolo[3,4-d]pyrimidine-2,4-dione CAS Name: 5-anilino-6-[(6-chloro-3-pyridinyl)methyl]-3-methyl-1-[(1-methyl-2-pyrrolidinyl)methyl]pyrrolo[3,4-d]pyrimidine-2,4-dione IUPAC Name: 5-anilino-6-[(6-chloropyridin-3-yl)methyl]-3-methyl-1-[(1-methylpyrrolidin-2-yl)methyl]pyrrolo[3,4-d]pyrimidine-2,4-dione Traditional Name: 5-anilino-6-[(6-chloro-3-pyridyl)methyl]-3-methyl-1-[(1-methylpyrrolidin-2-yl)methyl]pyrrolo[3,4-d]pyrimidine-2,4-quinone Formula: C25H27ClN6O2 MolecularWeight: 478.97388

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCCC1CN2C3=CN(C(=C3C(=O)N(C2=O)C)NC4=CC=CC=C4)CC5=CN=C(C=C5)Cl

Isomeric SMILES

CN1CCCC1CN2C3=CN(C(=C3C(=O)N(C2=O)C)NC4=CC=CC=C4)CC5=CN=C(C=C5)Cl

InChI

InChI=1S/C25H27ClN6O2/c1-29-12-6-9-19(29)15-32-20-16-31(14-17-10-11-21(26)27-13-17)23(28-18-7-4-3-5-8-18)22(20)24(33)30(2)25(32)34/h3-5,7-8,10-11,13,16,19,28H,6,9,12,14-15H2,1-2H3